⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2578 | 0.90 | — | — | |
| SCHEMBL29133592 | 0.90 | TSHR (0.32) | — | |
| Water SCHEMBL27760872 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL27536311 | 0.87 | — | — | |
| SCHEMBL28176518 | 0.87 | — | — | |
| SCHEMBL30336744 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL11735071 | 0.87 | — | — | |
| Fluoride SCHEMBL15259547 | 0.87 | — | — | |
| Propane SCHEMBL27727117 | 0.87 | — | — | |
| Methane SCHEMBL27633340 | 0.87 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108137760-A | (meth) acrylic copolymer, polymer solution, polymer-containing composition, antifouling coating composition, and method for producing (meth) acrylic copolymer | 三菱化学株式会社 | 2018-06-08 | — | — | CN | disclosed |